UCSF

ZINC03260326

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2004 14 Yes

Popular Name: 2-cyano-N-(4-ethylphenyl)acetamide 2-cyano-N-(4-ethylphenyl)acetamide

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CAS Numbers: , 340304-99-6 , [340304-99-6]

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.49 5.32 -17.26 1 3 0 53 188.23 3 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Warnings IRRITANT Matrix Scientific

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